2-methoxy-3-pentan-2-yloxycyclobutan-1-ol

C10H20O3 — CID 102988631

IUPAC2-methoxy-3-pentan-2-yloxycyclobutan-1-ol
SMILESCCCC(C)OC1CC(O)C1OC
InChIInChI=1S/C10H20O3/c1-4-5-7(2)13-9-6-8(11)10(9)12-3/h7-11H,4-6H2,1-3H3
InChIKeySBXFXUYHPYNMIL-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.34
Rot. Bonds5

About 2-methoxy-3-pentan-2-yloxycyclobutan-1-ol

2-methoxy-3-pentan-2-yloxycyclobutan-1-ol (PubChem CID 102988631) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-methoxy-3-pentan-2-yloxycyclobutan-1-ol.

Molecular Properties

Compound Name2-methoxy-3-pentan-2-yloxycyclobutan-1-ol
PubChem CID102988631
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name2-methoxy-3-pentan-2-yloxycyclobutan-1-ol
SMILESCCCC(C)OC1CC(O)C1OC
InChIInChI=1S/C10H20O3/c1-4-5-7(2)13-9-6-8(11)10(9)12-3/h7-11H,4-6H2,1-3H3
InChIKeySBXFXUYHPYNMIL-UHFFFAOYSA-N
XLogP1.34
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Dibuprol
CID 16669
3-Butoxy-1,2-propanediol
CID 263027
1-O-Pentylglycerol
CID 90819
(2S)-2-butoxybutan-1-ol
CID 21225521
CID 3084433
CID 3084433
2,3-Bis(1-methylethoxy)-1-propanol
CID 113734
Rac-(1s,3s)-3-[2-(tert-butoxy)ethoxy]cyclobutan-1-ol
CID 112590640
Propanol, 2-ethylbutoxy-, mixed isomers
CID 113757
rac-(1R,2R,3R)-3-(tert-butoxy)-2-methoxycyclobutan-1-ol
CID 155858890
(2R)-3-butoxypropane-1,2-diol
CID 6993313
(2S,13S)-12,13-Dihydroxy-1,4,7,10-tetraoxacyclotetradecane
CID 14004858
2-Butoxypropane-1,3-diol
CID 69355

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-pentan-2-yloxycyclobutan-1-ol?
The IUPAC name of 2-methoxy-3-pentan-2-yloxycyclobutan-1-ol (CID 102988631) is 2-methoxy-3-pentan-2-yloxycyclobutan-1-ol.
What is the SMILES notation for 2-methoxy-3-pentan-2-yloxycyclobutan-1-ol?
The canonical SMILES for 2-methoxy-3-pentan-2-yloxycyclobutan-1-ol is CCCC(C)OC1CC(O)C1OC.
What is the InChIKey of 2-methoxy-3-pentan-2-yloxycyclobutan-1-ol?
The InChIKey is SBXFXUYHPYNMIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-4-5-7(2)13-9-6-8(11)10(9)12-3/h7-11H,4-6H2,1-3H3.
What are the key properties of 2-methoxy-3-pentan-2-yloxycyclobutan-1-ol?
2-methoxy-3-pentan-2-yloxycyclobutan-1-ol has a molecular weight of 188.27 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-pentan-2-yloxycyclobutan-1-ol is sourced from PubChem (CID 102988631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).